1-chloranyl-N-methyl-N-(thiophen-3-ylmethyl)isoquinoline-3-carboxamide

Systemtic Name: 1-chloranyl-N-methyl-N-(thiophen-3-ylmethyl)isoquinoline-3-carboxamide Openeye Name: 1-chloro-N-methyl-N-(3-thienylmethyl)isoquinoline-3-carboxamide CAS Name: 1-chloro-N-methyl-N-(3-thiophenylmethyl)-3-isoquinolinecarboxamide IUPAC Name: 1-chloro-N-methyl-N-(thiophen-3-ylmethyl)isoquinoline-3-carboxamide Traditional Name: 1-chloro-N-methyl-N-(3-thenyl)isoquinoline-3-carboxamide Formula: C16H13ClN2OS MolecularWeight: 316.80522

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CSC=C1)C(=O)C2=CC3=CC=CC=C3C(=N2)Cl

Isomeric SMILES

CN(CC1=CSC=C1)C(=O)C2=CC3=CC=CC=C3C(=N2)Cl

InChI

InChI=1S/C16H13ClN2OS/c1-19(9-11-6-7-21-10-11)16(20)14-8-12-4-2-3-5-13(12)15(17)18-14/h2-8,10H,9H2,1H3